N-butanoylcyclopropanecarboxamide

C8H13NO2 — CID 89311157

IUPACN-butanoylcyclopropanecarboxamide
SMILESCCCC(=O)NC(=O)C1CC1
InChIInChI=1S/C8H13NO2/c1-2-3-7(10)9-8(11)6-4-5-6/h6H,2-5H2,1H3,(H,9,10,11)
InChIKeyLBDLXWPGQVKCDA-UHFFFAOYSA-N
MW155.20 g/mol
LogP0.84
Rot. Bonds3

About N-butanoylcyclopropanecarboxamide

N-butanoylcyclopropanecarboxamide (PubChem CID 89311157) has the molecular formula C8H13NO2 and a molecular weight of 155.20 g/mol. Its IUPAC name is N-butanoylcyclopropanecarboxamide.

Molecular Properties

Compound NameN-butanoylcyclopropanecarboxamide
PubChem CID89311157
Molecular FormulaC8H13NO2
Molecular Weight155.20 g/mol
Exact Mass155.09
IUPAC NameN-butanoylcyclopropanecarboxamide
SMILESCCCC(=O)NC(=O)C1CC1
InChIInChI=1S/C8H13NO2/c1-2-3-7(10)9-8(11)6-4-5-6/h6H,2-5H2,1H3,(H,9,10,11)
InChIKeyLBDLXWPGQVKCDA-UHFFFAOYSA-N
XLogP0.84
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.20
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(butanoylamino)carbamothioyl]cyclohexanecarboxamide
CID 17340126
N-(heptan-4-ylideneamino)cyclopropanecarboxamide
CID 4282887
N-[4-(butylamino)-4-oxobutyl]cyclopropanecarboxamide
CID 3067803
1-(4-butanoylcyclohexyl)butan-1-one
CID 21294983
N-but-1-en-2-ylbutanamide
CID 159787043
N-[(4-chlorocyclohexyl)methyl]butanamide
CID 106133703
ethyl N-(cyclopropanecarbonyl)carbamate
CID 45084465
(3R)-N-pentanoylpiperidine-3-carboxamide
CID 174696640
N-[3-(butanoylamino)phenyl]cyclopropanecarboxamide
CID 17187554
N-(methylcarbamoyl)butanamide
CID 12936929
N-[[5-(butanoylamino)-2-chlorophenyl]carbamothioyl]cyclopropanecarboxamide
CID 17174622
N-[4-(butanoylamino)-2,5-diethoxyphenyl]cyclopropanecarboxamide
CID 1428132

Frequently Asked Questions

What is the IUPAC name of N-butanoylcyclopropanecarboxamide?
The IUPAC name of N-butanoylcyclopropanecarboxamide (CID 89311157) is N-butanoylcyclopropanecarboxamide.
What is the SMILES notation for N-butanoylcyclopropanecarboxamide?
The canonical SMILES for N-butanoylcyclopropanecarboxamide is CCCC(=O)NC(=O)C1CC1.
What is the InChIKey of N-butanoylcyclopropanecarboxamide?
The InChIKey is LBDLXWPGQVKCDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO2/c1-2-3-7(10)9-8(11)6-4-5-6/h6H,2-5H2,1H3,(H,9,10,11).
What are the key properties of N-butanoylcyclopropanecarboxamide?
N-butanoylcyclopropanecarboxamide has a molecular weight of 155.20 g/mol, XLogP of 0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-butanoylcyclopropanecarboxamide is sourced from PubChem (CID 89311157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).